{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5110912000000001 0.33769240000000006 -0.7790682000000002 ] [ -0.33199190000000006 0.8238656000000002 -1.3171677000000002 ] [ -0.32632760000000005 0.20114890000000005 -1.1353271000000003 ] [ -0.022855500000000004 2.3934684000000006 -1.0266172000000002 ] [ 0.19475700000000007 -2.5805805000000004 -0.7354982000000001 ] [ 0.9198633000000003 0.32623490000000005 0.9507675000000002 ] [ -0.25783760000000006 -2.3898135000000003 1.2701282000000003 ] [ -0.6866989000000001 0.8879839000000003 2.7727826000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.188583717366171e-10 5.41042868301842e-10 -1.248204856048739e-09 ] [ -5.319096604749717e-10 1.319978203001365e-09 -2.110335294612909e-09 ] [ -5.228344514417742e-10 3.222760648796372e-10 -1.818994536580664e-09 ] [ -3.661854775669441e-11 3.834759113103583e-09 -1.644822076351158e-09 ] [ 3.120351121371457e-10 -4.134545745192375e-09 -1.178398020680483e-09 ] [ 1.473783473591937e-09 5.22685929669026e-10 1.523297460316464e-09 ] [ -4.131013746831821e-10 -3.828903317772222e-09 2.034969707458787e-09 ] [ -1.100212923109077e-09 1.422707044226805e-09 4.44248745628104e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.527812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.449135708337769e-18 } }